N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-4H-1,4-benzothiazine-6-carboxamide Formula: C19H21N4O3S+ MolecularWeight: 385.46004

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C19H20N4O3S/c24-18-12-27-16-3-2-14(9-15(16)22-18)19(25)21-11-13-1-4-17(20-10-13)23-5-7-26-8-6-23/h1-4,9-10H,5-8,11-12H2,(H,21,25)(H,22,24)/p+1